ATOMIC AND ELECTRONIC STRUCTURE OF SOLIDS

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Electronic Structure And The Properties Of Solids

Author : Walter A. Harrison
ISBN : 9780486141787
Genre : Science
File Size : 38.82 MB
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This text offers basic understanding of the electronic structure of covalent and ionic solids, simple metals, transition metals and their compounds; also explains how to calculate dielectric, conducting, bonding properties.
Category: Science

Electronic Structure Of Materials

Author : Adrian P. Sutton
ISBN : 9780191588532
Genre :
File Size : 48.48 MB
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This book describes the modern real-space approach to electronic structures and properties of crystalline and non-crystalline materials in a form readily accessible to undergraduates in materials science, physics, and chemistry. - ;This book describes the modern real-space approach to electronic structures and properties of crystalline and non-crystalline materials in a form readily accessible to undergraduates in materials science, physics, and chemistry. -
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Electronic Structure Of Solids 91

Author : Technische Universität Dresden. Institut für Theoretische Physik
ISBN : 3055015045
Genre : Science
File Size : 80.10 MB
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Category: Science

Elektrische Leitungsph Nomene I Electrical Conductivity I

Author : S. Flügge
ISBN : 3540020403
Genre : Science
File Size : 23.51 MB
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191 Apart from numerous difficulties arising from the high pressure technique as such, there is a natural limitation to the possibility of applying a hydrostatic pressure, since liquids under pressure will solidify above a certain pressure limit. 8 2 Up to pressures of 3 X 10 kg.jm. at room temperature, a liquid like isopentane can be used. For higher pressures helium gas may be used, perhaps to about 9 2 10 kg.jm. , but BRIDGMAN already encountered enormous leakage difficulties 7 when using this gas at 7.10 kg.jm.2 at 90° K. A solution has been found by applying mechanical pressure for the range 8 9 2 between 3 X 10 and 10 kg.jm. , by using silver chloride as transmittant. In this case, however, one has to apply unknown corrections for shearing stress and deformation of the sample, a problem which BRIDGMAN solved experimentally by a determination of the resistivity in the pressure region between 2 and 8 2 5 X 10 kg.jm. , by the hydrostatic and by the mechanical pressure method as well, and applying the correction factor thus determined to the results obtained at higher pressures. Though this method seems to be right in good approximation, the data for the highest pressures are to be considered as less accurate.
Category: Science

Orbital Approach To The Electronic Structure Of Solids

Author : Enric Canadell
ISBN : 9780199534937
Genre : Science
File Size : 36.14 MB
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This book is aiming at filling the gap between the different languages of the physics and chemistry communities to understand the electronic structure of solids. How structure and properties of solids are related is illustrated by considering in detail a large number of real examples.
Category: Science

The Electronic Structures Of Solids

Author : B. R. Coles
ISBN : 9781483280127
Genre : Science
File Size : 76.97 MB
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The Electronic Structures of Solids aims to provide students of solid state physics with the essential concepts they will need in considering properties of solids that depend on their electronic structures and idea of the electronic character of particular materials and groups of materials. The book first discusses the electronic structure of atoms, including hydrogen atom and many-electron atom. The text also underscores bonding between atoms and electrons in metals. Discussions focus on bonding energies and structures in the solid elements, eigenstates of free-electron gas, and electrical conductivity. The manuscript reviews the presence of electrons in metals, as well as consequences of the periodic potential; Brillouin zones and the nearly-free-electron model; electronic structures of the metallic elements; and calculation of band structures. The text also ponders on metals, insulators, and semiconductors. Topics include full and empty bands, compound and doped semiconductors, optical properties of solids, and the dynamics of electron and holes. The book is a dependable reference for readers and students of solid state physics interested in the electronic structure of solids.
Category: Science

Electronic Structure Calculations For Solids And Molecules

Author : Jorge Kohanoff
ISBN : 9781139453486
Genre : Science
File Size : 66.14 MB
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Electronic structure problems are studied in condensed matter physics and theoretical chemistry to provide important insights into the properties of matter. This 2006 graduate textbook describes the main theoretical approaches and computational techniques, from the simplest approximations to the most sophisticated methods. It starts with a detailed description of the various theoretical approaches to calculating the electronic structure of solids and molecules, including density-functional theory and chemical methods based on Hartree-Fock theory. The basic approximations are thoroughly discussed, and an in-depth overview of recent advances and alternative approaches in DFT is given. The second part discusses the different practical methods used to solve the electronic structure problem computationally, for both DFT and Hartree-Fock approaches. Adopting a unique and open approach, this textbook is aimed at graduate students in physics and chemistry, and is intended to improve communication between these communities. It also serves as a reference for researchers entering the field.
Category: Science

Electronic Structure And Physical Properties Of Solids

Author : Hugues Dreysse
ISBN : 9783540464372
Genre : Science
File Size : 31.49 MB
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A very comprehensive book, enabling the reader to understand the basic formalisms used in electronic structure determination and particularly the "Muffin Tin Orbitals" methods. The latest developments are presented, providing a very detailed description of the "Full Potential" schemes. This book will provide a real state of the art, since almost all of the contributions on formalism have not been, and will not be, published elsewhere. This book will become a standard reference volume. Moreover, applications in very active fields of today's research on magnetism are presented. A wide spectrum of such questions is covered by this book. For instance, the paper on interlayer exchange coupling should become a "classic", since there has been fantastic experimental activity for 10 years and this can be considered to be the "final" theoretical answer to this question. This work has never been presented in such a complete form.
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Quantum Chemistry Of Solids

Author : Robert A. Evarestov
ISBN : 9783642303562
Genre : Science
File Size : 78.39 MB
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Quantum Chemistry of Solids delivers a comprehensive account of the main features and possibilities of LCAO methods for the first principles calculations of electronic structure of periodic systems. The first part describes the basic theory underlying the LCAO methods applied to periodic systems and the use of Hartree-Fock(HF), Density Function theory(DFT) and hybrid Hamiltonians. The translation and site symmetry consideration is included to establish connection between k-space solid –state physics and real-space quantum chemistry. The inclusion of electron correlation effects for periodic systems is considered on the basis of localized crystalline orbitals. The possibilities of LCAO methods for chemical bonding analysis in periodic systems are discussed. The second part deals with the applications of LCAO methods for calculations of bulk crystal properties, including magnetic ordering and crystal structure optimization. In the second edition two new chapters are added in the application part II of the book. Chapter 12 deals with the recent LCAO calculations and illustrates the efficiency of the scalar-relativistic LCAO method for solids, containing heavy atoms. Chapter 13 deals with the symmetry properties and the recent applications of LCAO method to inorganic nanotubes. New material is added to chapter 9 devoted to LCAO calculations of perfect-crystal properties. The possibilities of LCAO method for calculation of the high-frequency dielectric constants of crystals and the description of phase transitions in solids are discussed. The efficiency of LCAO method in the quantum-mechanics-molecular dynamics approach to the interpretation of x-ray absorption and EXAFS spectra is illustrated. A new section is devoted to recent LCAO calculations of electronic, vibrational and magnetic properties of tungstates MeWO4 (Me: Fe,Co,Ni,Cu,Zn,Cd).
Category: Science